7-methyl-1-[4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione

Systemtic Name: 7-methyl-1-[4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione Openeye Name: 7-methyl-1-[4-[4-(2-pyridyl)piperazin-1-yl]butyl]-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione CAS Name: 7-methyl-1-[4-[4-(2-pyridinyl)-1-piperazinyl]butyl]-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione IUPAC Name: 7-methyl-1-[4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione Traditional Name: 7-methyl-1-[4-[4-(2-pyridyl)piperazino]butyl]-5,6-dihydropyrrol[2,3-c]azepine-4,8-quinone Formula: C22H29N5O2 MolecularWeight: 395.49796

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(=O)C2=C(C1=O)N(C=C2)CCCCN3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CN1CCC(=O)C2=C(C1=O)N(C=C2)CCCCN3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C22H29N5O2/c1-24-12-8-19(28)18-7-13-27(21(18)22(24)29)11-5-4-10-25-14-16-26(17-15-25)20-6-2-3-9-23-20/h2-3,6-7,9,13H,4-5,8,10-12,14-17H2,1H3